Basic information
- Standard SMILES
CC(C)=CCc1c(O)ccc(C(=O)C=Cc2ccc(O)cc2O)c1O- InChIKey
NXBYIJSAISXPKJ-UHFFFAOYSA-N- Molecular formula
- C20H20O5
- Average molar mass
- 340.4 g/mol
- Monoisotopic mass
- 340.13107373
Names & identifiers
- Preferred name
- 2-Propen-1-one, 1-[2,4-dihydroxy-3-(3-methyl-2-butenyl)phenyl]-3-(2,4-dihydroxyphenyl)-, (E)-; (2E)-1-[2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-3-(2,4-dihydroxyphenyl)-2-propen-1-one
- IUPAC
- 1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-(2,4-dihydroxyphenyl)prop-2-en-1-one
Names & synonyms
2-Propen-1-one, 1-[2,4-dihydroxy-3-(3-methyl-2-butenyl)phenyl]-3-(2,4-dihydroxyphenyl)-, (E)-; (2E)-1-[2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-3-(2,4-dihydroxyphenyl)-2-propen-1-one2,4,2',4'-tetrahydroxy-3'-prenylchalconeSCHEMBL6818976NXBYIJSAISXPKJ-UHFFFAOYSA-NBDA47288AKOS0329624431-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-(2,4-dihydroxyphenyl)prop-2-en-1-one
Database identifiers
- PubChem CID
- 69906284
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 98 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 508
Related reactions
1 records
Compound notes
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